5-(Cis-1,4-Dihydroxycyclohexyl)-4-Hydroxy-3-[(2E,4E,6E)-8-(Hydroxymethyl)-2,4,6-Decatrienoyl]-2(1H)-Pyridinone
Properties
Property | Value |
---|---|
Formula | C22H29NO6 |
IUPAC Name | 5-(1,4-dihydroxycyclohexyl)-4-hydroxy-3-[(2e,4e,6e,8s)-8-(hydroxymethyl)deca-2,4,6-trienoyl]-1h-pyridin-2-one |
Molecular Mass | 403.469 g·mol−1 |
Heat of Formation | -1040.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.41 ± 1.08 D |
Volume | 487.25 Å 3 |
Surface Area | 434.95 Å 2 |
HOMO Energy | -9.11 ± 0.55 eV |
LUMO Energy | 1.87 ± eV |
Point Group Symmetry | C1 |
InChIKey | KQURUXJOTYKSMO-PNPVSWLZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |